4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide

C15H15IN2O — CID 166438575

IUPAC4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide
SMILESCC(C)(NC(=O)c1ccc(I)cc1)c1ccccn1
InChIInChI=1S/C15H15IN2O/c1-15(2,13-5-3-4-10-17-13)18-14(19)11-6-8-12(16)9-7-11/h3-10H,1-2H3,(H,18,19)
InChIKeyOKUXDVWADJYAGT-UHFFFAOYSA-N
MW366.20 g/mol
LogP3.35
Rot. Bonds3

About 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide

4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide (PubChem CID 166438575) has the molecular formula C15H15IN2O and a molecular weight of 366.20 g/mol. Its IUPAC name is 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide
PubChem CID166438575
Molecular FormulaC15H15IN2O
Molecular Weight366.20 g/mol
Exact Mass366.02
IUPAC Name4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide
SMILESCC(C)(NC(=O)c1ccc(I)cc1)c1ccccn1
InChIInChI=1S/C15H15IN2O/c1-15(2,13-5-3-4-10-17-13)18-14(19)11-6-8-12(16)9-7-11/h3-10H,1-2H3,(H,18,19)
InChIKeyOKUXDVWADJYAGT-UHFFFAOYSA-N
XLogP3.35
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.20
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(2-pyridin-2-ylpropan-2-yl)pyridine-4-carboxamide
CID 110870482
N-(2-pyridin-2-ylpropan-2-yl)thiophene-2-carboxamide
CID 110870459
4-iodo-2-(5-methylthiophen-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 166442652
2,6-di(propan-2-yl)-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 87976563
N-[methoxy(dipyridin-2-yl)methyl]benzamide
CID 123194279
3-chloro-2,2-dimethyl-N-(2-pyridin-2-ylpropan-2-yl)propanamide
CID 82108663
2,6-dimethyl-4-propan-2-yl-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 132505720
1-methyl-N-(2-pyridin-2-ylpropan-2-yl)indazole-3-carboxamide
CID 166081591
N-(2-pyridin-2-ylpropan-2-yl)pentalene-1-carboxamide
CID 141292841
2-(4-methylphenyl)-N-(2-pyridin-2-ylpropan-2-yl)acetamide
CID 113091918
2,4-dimethoxy-N-(2-pyridin-2-ylpropan-2-yl)benzamide
CID 135066856
4-iodo-N-[[4-oxo-4-(pyridin-2-ylamino)butan-2-ylidene]amino]benzamide
CID 3101281

Frequently Asked Questions

What is the IUPAC name of 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The IUPAC name of 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide (CID 166438575) is 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide is CC(C)(NC(=O)c1ccc(I)cc1)c1ccccn1.
What is the InChIKey of 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
The InChIKey is OKUXDVWADJYAGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IN2O/c1-15(2,13-5-3-4-10-17-13)18-14(19)11-6-8-12(16)9-7-11/h3-10H,1-2H3,(H,18,19).
What are the key properties of 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide?
4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide has a molecular weight of 366.20 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodo-N-(2-pyridin-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 166438575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).